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1-Ethyl-2,5-dimethoxy-4-[(1E)-2-nitro-1-propenyl]benzene
SpectraBase Compound ID 80bCI8nE27o
InChI InChI=1S/C13H17NO4/c1-5-10-7-13(18-4)11(8-12(10)17-3)6-9(2)14(15)16/h6-8H,5H2,1-4H3/b9-6+
InChIKey HYEPISFVKUWBAR-RMKNXTFCSA-N
Mol Weight 251.28 g/mol
Molecular Formula C13H17NO4
Exact Mass 251.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4YjAxM5BZ9u
Name 1-Ethyl-2,5-dimethoxy-4-[(1E)-2-nitro-1-propenyl]benzene
CAS Registry Number 30431-62-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO4
InChI InChI=1S/C13H17NO4/c1-5-10-7-13(18-4)11(8-12(10)17-3)6-9(2)14(15)16/h6-8H,5H2,1-4H3/b9-6+
InChIKey HYEPISFVKUWBAR-RMKNXTFCSA-N
Molecular Weight 251.282 g/mol
SMILES c1(\C=C/(N(=O)=O)C)c(cc(c(c1)OC)CC)OC
SPLASH splash10-0udi-3950000000-72fa8be3eebe2637cd2a
Source of Spectrum JZ-1992-4351-0
Synonyms 1-Ethyl-2,5-dimethoxy-4-[(E)-2-nitroprop-1-enyl]benzene 2,5-Dimethoxy-4-ethyl-.beta.-methyl-.beta.-nitrostyrene
Wiley ID 1254479